Geometry & MOs

Info

ID:	333186
PubChem CID:	127251734
Reduced:	FS2O3N5H16C17 (1)
Stoich.:	AB2C3D5E16F17 (1)
Weight, g/mol:	398.119481
ΔH_f, kcal/mol:	-67.04
Dipole, Da:	11.26
IP(EA), eV:	-8.67(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-(diethylsulfamoyl)pyrrolidin-3-yl]-N-(1,3-thiazol-2-yl)-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC1C2=CC(=NN2)C(=O)NC3=NC=CS3)S(=O)(=O)C4=CC=C(C=C4)F

DOS

IR

Vibrations